Vitas-M small molecule compound

(2Z)-2-(3-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl diethylcarbamate

Catalog ID
STK858566
SMILES CCN(C(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)Cl)/C2=O)CC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H18ClNO4 MW 371.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClNO4/c1-3-22(4-2)20(24)25-15-8-9-16-17(12-15)26-18(19(16)23)11-13-6-5-7-14(21)10-13/h5-12H,3-4H2,1-2H3/b18-11-
InChIKey
IEVCYEFVCBOPOY-WQRHYEAKSA-N
Synonyms
622796-72-9
((2Z)2((3CHLOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)NNDIETHYLCARBAMATE
(2((3CHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)NNDIETHYLCARBOXAMIDE
(2Z)2(3chlorobenzylidene)3oxo23dihydro1benzofuran6yldiethylcarbamate
(Z)2(3chlorobenzylidene)3oxo23dihydrobenzofuran6yldiethylcarbamate
622796729
CCN(C(=O)Oc1ccc2c(c1)OC(=Cc1cccc(c1)Cl)C2=O)CC
CCN(CC)C(=O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC=C3)Cl)O2
InChI=1SC20H18ClNO4c1322(42)20(24)2515891617(1215)2618(19(16)23)111365714(21)1013h512H34H212H3b1811
MFCD04164526
ZINC000005966401
ZINC05966401
ZINC5966401

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.